[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate (CAS 94094-37-8) — formula C21H21ClN2O6S, molecular weight 464.9; category organic chemicals.
| CAS Number | 94094-37-8 |
|---|---|
| Molecular Formula | C21H21ClN2O6S |
| Molecular Weight | 464.9 |
| LogP | 2.7 |
| Category | Organic Chemicals |
[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate is a carbon-based organic compound with CAS registry number 94094-37-8 and molecular formula C21H21ClN2O6S (molecular weight 464.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94094-37-8
Its molecular formula C21H21ClN2O6S comprises 21 C, 21 H, 1 Cl, 2 N, 6 O, 1 S atoms.
Also known as: [2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate · [2-[[4-[3-(4-氯苯基)-4,5-二氢-1H-吡唑-1-基]苯基]磺酰基]乙基]琥珀酸氢酯
Category: organic chemicals
The CAS registry number of [2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate is 94094-37-8.
Molecular formula C21H21ClN2O6S, molecular weight 464.9.
It is also registered under: [2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate, [2-[[4-[3-(4-氯苯基)-4,5-二氢-1H-吡唑-1-基]苯基]磺酰基]乙基]琥珀酸氢酯.
Category: Organic Chemicals.
Independent reference data for [2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethyl] hydrogen succinate (CAS 94094-37-8), compiled from public chemistry databases.
| CAS 号 | 94094-37-8 |
|---|---|
| PubChem CID | 44151306 |
| 分子式 | C21H21ClN2O6S |
| IUPAC 名称 | 4-[2-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylethoxy]-4-oxobutanoic acid |
| UNII（FDA） | NS00040028 |
| Molecular Weight | 464.9 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 10 |
| Exact Mass | 464.0808853 |
| Monoisotopic Mass | 464.0808853 |
| Topological Polar Surface Area | 122 |
| Heavy Atom Count | 31 |
94094-37-8; EINECS 302-137-4; (2-((4-(3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)phenyl)sulphonyl)ethyl) hydrogen succinate; 4-[2-({4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl}sulfonyl)ethoxy]-4-oxobutanoic acid; DTXSID20240507; MXCCYYLUOIVZLE-UHFFFAOYSA-N; NS00040028; 4-(2-{4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}ethoxy)-4-oxobutanoic acid
[2-[[4-[3-(4-氯苯基)-4,5-二氢-1H-吡唑-1-基]苯基]磺酰基]乙基]琥珀酸氢酯 · CAS 94094-37-8 · C21H21ClN2O6S. UNII NS00040028.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.